2,3-dioctoxypropyl 4-methylbenzenesulfonate

Systemtic Name: 2,3-dioctoxypropyl 4-methylbenzenesulfonate Openeye Name: 2,3-dioctoxypropyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2,3-dioctoxypropyl ester IUPAC Name: 2,3-dioctoxypropyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2,3-dioctoxypropyl ester Formula: C26H46O5S MolecularWeight: 470.70544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(COS(=O)(=O)C1=CC=C(C=C1)C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOCC(COS(=O)(=O)C1=CC=C(C=C1)C)OCCCCCCCC

InChI

InChI=1S/C26H46O5S/c1-4-6-8-10-12-14-20-29-22-25(30-21-15-13-11-9-7-5-2)23-31-32(27,28)26-18-16-24(3)17-19-26/h16-19,25H,4-15,20-23H2,1-3H3